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36176-31-5,MFCD00022053
Catalog No.:AA003HF4

36176-31-5 | 2-ISOPROPYLPHENYL ISOTHIOCYANATE

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
1 week  
$322.00   $225.00
- +
5g
98%
1 week  
$393.00   $275.00
- +
25g
98%
1 week  
$608.00   $425.00
- +
100g
98%
1 week  
$1,765.00   $1,235.00
- +
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  • Technical Information
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Technical Information
Catalog Number:
AA003HF4
Chemical Name:
2-ISOPROPYLPHENYL ISOTHIOCYANATE
CAS Number:
36176-31-5
Molecular Formula:
C10H11NS
Molecular Weight:
177.2660
MDL Number:
MFCD00022053
SMILES:
S=C=Nc1ccccc1C(C)C
Properties
Computed Properties
 
Complexity:
182  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
2  
XLogP3:
4.4  

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
Tags:36176-31-5 Molecular Formula|36176-31-5 MDL|36176-31-5 SMILES|36176-31-5 2-ISOPROPYLPHENYL ISOTHIOCYANATE